Preferred Name |
ebastine |
|
Synonyms |
Ebastine Kestine (TN) bastel ebastel ebastin erostin kestine |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_31528 |
|
charge |
0 |
|
database_cross_reference |
Drug_Central:977 CAS:90729-43-4 KEGG:D01478 HMDB:HMDB0060159 |
|
formula |
C32H39NO2 |
|
has_exact_synonym |
Ebastine |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
Kestine (TN) bastel ebastel ebastin erostin kestine |
|
has_RxCUI |
23796 |
|
id |
CHEBI:31528 |
|
in_subset | ||
inchi |
InChI=1S/C32H39NO2/c1-32(2,3)28-18-16-25(17-19-28)30(34)15-10-22-33-23-20-29(21-24-33)35-31(26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-9,11-14,16-19,29,31H,10,15,20-24H2,1-3H3 |
|
inchikey |
MJJALKDDGIKVBE-UHFFFAOYSA-N |
|
label |
Ebastine ebastine |
|
mass |
469.659 |
|
monoisotopicmass |
469.29808 |
|
notation |
CHEBI:31528 |
|
prefLabel |
ebastine |
|
smiles |
C(OC1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)C(C)(C)C)(C3=CC=CC=C3)C4=CC=CC=C4 |
|
subClassOf |
Create mapping